SCHEMBL30009368

SCHEMBL30009368

CC1CC(C(=O)c2ccccc2)c2ccc(F)cc2N(C)C1=O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 4/20 0.38
PYGL P06737 1/20 0.37
PYGM P11217 1/20 0.37
HSD11B1 P28845 4/20 0.36
PARK7 Q99497 1/20 0.36
MEN1 O00255 2/20 0.35
RECQL P46063 1/20 0.35
BRD4 O60885 2/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30009601 0.77 ALDH1A1 (0.47) MAPTHPGDKMT2AMEN1BRD4
SCHEMBL30009284 0.77 KMT2A (0.49) MAPTHPGDKMT2AMEN1BRD4
SCHEMBL30009926 0.76 HTT (0.46) MAPTHPGDKMT2AMEN1
SCHEMBL30009649 0.70 ACHE (0.41) MAPTHPGDKMT2AHSD11B1MEN1
SCHEMBL26688764 0.70 GRIA1 (0.37) KMT2APYGLPYGMPARK7MEN1
SCHEMBL30009059 0.70 KMT2A (0.53) KMT2AMEN1BRD4
SCHEMBL21680919 0.67 NR1H2 (0.41) MAPTKMT2AMEN1
SCHEMBL28250154 0.67 ACHE (0.53) MAPTHPGDPYGLPYGMBRD4
SCHEMBL30009915 0.66 ACHE (0.41) MAPTHPGDKMT2AMEN1
SCHEMBL19953484 0.64 GRM7 (0.43) MAPTKMT2APYGLPYGMMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115141212-A Synthetic method of benzoazacyclo skeleton containing oxygen bridged ring 南通大学 2022-10-04 CN claimed
CN-115141212-A Synthetic method of benzoazacyclo skeleton containing oxygen bridged ring 南通大学 2022-10-04 CN disclosed